CHEMBL2347239


SMILES C[C@H]1C2Cc3ccc(C(=O)NCCc4ccc(-c5ccccc5)cn4)cc3[C@@]1(C)CCN2CC1CC1
InChIKey MJYXXZICLYPENA-WTBOZYSNSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 479.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Human Opioid A pKi 8.19 8.19 8.19 ChEMBL
κ OPRK Human Opioid A pKi 8.85 8.85 8.85 ChEMBL
μ OPRM Human Opioid A pKi 9.09 9.09 9.09 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
κ OPRK Human Opioid A pEC50 7.85 7.85 7.85 ChEMBL
μ OPRM Human Opioid A pIC50 7.12 7.12 7.12 ChEMBL
μ OPRM Human Opioid A pEC50 7.72 7.72 7.72 ChEMBL